Information card for entry 4517475

Structure parameters

• Formula: C16 H22 Cl2 I4 N2 Pb
• Calculated formula: C16 H22 Cl2 I4 N2 Pb
• Title of publication: Tailoring Hot Exciton Dynamics in 2D Hybrid Perovskites through Cation Modification.
• Authors of publication: Straus, Daniel B.; Hurtado Parra, Sebastian; Iotov, Natasha; Zhao, Qinghua; Gau, Michael R.; Carroll, Patrick J.; Kikkawa, James M.; Kagan, Cherie R.
• Journal of publication: ACS nano
• Year of publication: 2020
• a: 33.2779 ± 0.0018 Å
• b: 6.1691 ± 0.0003 Å
• c: 6.1839 ± 0.0003 Å
• α: 90°
• β: 90.255 ± 0.003°
• γ: 90°
• Cell volume: 1269.51 ± 0.11 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.064
• Residual factor for significantly intense reflections: 0.0493
• Weighted residual factors for significantly intense reflections: 0.0853
• Weighted residual factors for all reflections included in the refinement: 0.089
• Goodness-of-fit parameter for all reflections included in the refinement: 1.211
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No